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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-V/beta-6' and Ligand = 'BDBM50497606'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Integrin alpha-V/beta-6


(Homo sapiens (Human))
BDBM50497606
PNG
(CHEMBL3356166)
Show SMILES COc1ccc(cc1)C(CC(O)=O)NC(=O)CCCCc1ccc2CCCNc2n1
Show InChI InChI=1S/C23H29N3O4/c1-30-19-12-9-16(10-13-19)20(15-22(28)29)26-21(27)7-3-2-6-18-11-8-17-5-4-14-24-23(17)25-18/h8-13,20H,2-7,14-15H2,1H3,(H,24,25)(H,26,27)(H,28,29)
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 501n/an/an/an/an/an/a



University of Nottingham

Curated by ChEMBL


Assay Description
Inhibition of integrin alphavbeta6 (unknown origin)-mediated K562 cell adhesion to LAPb1 coated surface by fluorescence analysis


ACS Med Chem Lett 5: 1207-12 (2014)


Article DOI: 10.1021/ml5002079
BindingDB Entry DOI: 10.7270/Q2K07781
More data for this
Ligand-Target Pair